skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-10-[[cyclohexyl(oxo)methyl]amino]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide
... > organooxygen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-10-[[cyclohexyl(oxo)methyl]amino]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-10-[[cyclohexyl(oxo)methyl]amino]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide

Preferred term

n-(2-aminophenyl)-4-[[[(2r,3s)-10-[[cyclohexyl(oxo)methyl]amino]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C37H47N5O5

inchi

  • InChI=1S/C37H47N5O5/c1-24-20-42(25(2)23-43)37(46)29-12-9-15-32(40-35(44)27-10-5-4-6-11-27)34(29)47-33(24)22-41(3)21-26-16-18-28(19-17-26)36(45)39-31-14-8-7-13-30(31)38/h7-9,12-19,24-25,27,33,43H,4-6,10-11,20-23,38H2,1-3H3,(H,39,45)(H,40,44)/t24-,25-,33-/m0/s1

inchikey

  • QDRBVCQGVAHXBS-TZNXZYKKSA-N

mass

  • 641.801

monoisotopicmass

  • 641.35772

smiles

  • C[C@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)C3CCCCC3)O[C@H]1CN(C)CC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:94886

Download this concept:

RDF/XML TURTLE JSON-LD